Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKNKVEAILREMGDQSALNEVTPVSGGDISRAFQAKTA--NGVYFIKINDKAPEDFFLKEAEGLNLLRQAGALP-VPQVYYVSPPSA-----EDGYIIMEWVKG-ES-----APNTESRLGHGLALLHQHTHTHYGLAENNYIGRLPQPNRWEKSWTRFLREH--RLGF--QAKLAEKR-GRLPAGRKTRLEKLLDRLE---QWVP-DYRQPVLLHGDLWSGNWLAGPRGEPYLIDPA-VFYGEREFELAFTELFG-------GFSPRFYAAYRDVQPLSDNYEEVRPLYQLYYLLVHLNLFGESYGPSVDRILTYYAG 3I1A Chain:B ((11-292)) ----LIELLKVHY-GIDIHTAQFIQGGADTNAFAYQADSESKSYFIKLKYGY---HDEINLSIIRLLHDS-GIKEIIFPIHTLEAKLFQQLKHFKIIAYPFIHAPNGFTQNLTGKQWKQLGKVLRQIHETSVPISIQQQ---LRK----EIYSPKWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVWNKPHEIQYFYEGYGEINV----DKTILSYYRHERIVEDIAVY-----------------

General information: TITO was launched using: RESULT: Template: 3I1A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 951 -6053 -6.36 -24.12 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : -6.36 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.303

(partial model without unconserved sides chains): PDB file : Tito_3I1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3i1a-query.scw PDB file : Tito_Scwrl_3I1A.pdb: